Geometry & MOs

Info

ID:	274808
PubChem CID:	103811797
Reduced:	OSN2C12H26 (1)
Stoich.:	ABC2D12E26 (1)
Weight, g/mol:	246.176585
ΔH_f, kcal/mol:	-92.45
Dipole, Da:	1.83
IP(EA), eV:	-8.47(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(4-ethylsulfanylbutan-2-yl)-4-methylpentanamide

Drug info:

PubChemData

Smile

CCSCCC(C)NC(=O)[C@H](C(C)(C)C)N

DOS

IR

Vibrations